Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | CFTR | P13569 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.40 |
| ▸ | F7 | P08709 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Bromide SCHEMBL6279795 | 0.98 | CYP17A1 (0.48) | CYP17A1MAPTRAB9AKMT2AESR1 | |
| SCHEMBL7140967 | 0.87 | SMN1; SMN2 (0.51) | LMNASMN1; SMN2ALDH1A1APPGAA | |
| SCHEMBL7142799 | 0.86 | NAMPT (0.49) | MAPTRAB9AKMT2ALMNASMN1; SMN2 | |
| SCHEMBL7149214 | 0.86 | POLB (0.51) | RAB9AKMT2ALMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL7144713 | 0.86 | CYP19A1 (0.53) | MAPTRAB9AKMT2ALMNASMN1; SMN2 | |
| Bromide SCHEMBL6282444 | 0.86 | SMN1; SMN2 (0.50) | LMNASMN1; SMN2ALDH1A1APPGAA | |
| Bromide SCHEMBL6284312 | 0.85 | CYP19A1 (0.51) | MAPTRAB9AKMT2ALMNASMN1; SMN2 | |
| Bromide SCHEMBL6276160 | 0.85 | NAMPT (0.48) | MAPTRAB9AKMT2ALMNASMN1; SMN2 | |
| Bromide SCHEMBL6283209 | 0.85 | POLB (0.50) | RAB9AKMT2ASMN1; SMN2ALDH1A1GAA | |
| SCHEMBL7147866 | 0.82 | TRPV1 (0.52) | MAPTRAB9ALMNASMN1; SMN2ALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6620825-B1 | 1,3-Azole compound substituted by pyridyl; administering as antiasthmatic, antiinflammatory or antiallergen agents | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2003-09-16 | — | — | US | disclosed |
| US-6436966-B1 | Adenosine A3 receptor antagonists | TAKEDA CHEMICAL IND., LTD. (JP) | 2002-08-20 | — | — | US | disclosed |